Water → HCID 178522483, compound

HRID 1238341Notes

Reaction equation

HRID 1238341 reaction equation
[CH3:39][N:40]1[CH2:41][CH2:42][CH2:43][C:44]1=[O:45].[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][c:11]3[c:12]([nH:13][c:14]([NH:16][C:17](=[O:18])[c:19]4[n:20][c:21]5[n:22]([n:23][c:24]([Cl:27])[cH:25][cH:26]5)[cH:28]4)[n:15]3)[cH:29][cH:30]2)[cH:5][c:6]([F:8])[cH:7]1.[NH:31]1[CH2:32][CH2:33][CH:34]([OH:37])[CH2:35][CH2:36]1.[OH2:38]>>[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[cH:10][c:11]3[c:12]([nH:13][c:14]([NH:16][C:17](=[O:18])[c:19]4[n:20][c:21]5[n:22]([n:23][c:24]([N:31]6[CH2:32][CH2:33][CH:34]([OH:37])[CH2:35][CH2:36]6)[cH:25][cH:26]5)[cH:28]4)[n:15]3)[cH:29][cH:30]2)[cH:5][c:6]([F:8])[cH:7]1

Participants

5

Reactant 4

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 79341Piperidin-4-olHCID 178522482HCID 178522482, compound

Product 1

HCID 178522483HCID 178522483, compound

Sources & evidence

ORD record
ord-79a313f595b64916a07370d9bd1b021b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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